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2-(1,3-benzodioxol-4-ylmethyl)butanoate

2-(1,3-benzodioxol-4-ylmethyl)butanoate

Systemtic Name:2-(1,3-benzodioxol-4-ylmethyl)butanoate
Openeye Name:2-(1,3-benzodioxol-4-ylmethyl)butanoate
CAS Name:2-(1,3-benzodioxol-4-ylmethyl)butanoate
IUPAC Name:2-(1,3-benzodioxol-4-ylmethyl)butanoate
Traditional Name:2-(1,3-benzodioxol-4-ylmethyl)butyrate
Formula: C12H13O4-
MolecularWeight: 221.22922
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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=C2C(=CC=C1)OCO2)C(=O)[O-]


Isomeric SMILES

CCC(CC1=C2C(=CC=C1)OCO2)C(=O)[O-]


InChI

InChI=1S/C12H14O4/c1-2-8(12(13)14)6-9-4-3-5-10-11(9)16-7-15-10/h3-5,8H,2,6-7H2,1H3,(H,13,14)/p-1


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